SCHEMBL19986056

SCHEMBL19986056

c1ccc2c(c1)oc1c2c2c3ccccc3c3ccccc3c2c2c3ccccc3n(-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c12

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.33
PLA2G4A P47712 3/20 0.33
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
BRCA1 P38398 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HTT P42858 1/20 0.32
PPARG P37231 3/20 0.31
RXFP1 Q9HBX9 3/20 0.31
NR2E3 Q9Y5X4 3/20 0.31
NCOR2 Q9Y618 3/20 0.31
NPSR1 Q6W5P4 2/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALOX5 P09917 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19986066 0.93 ALDH1A1 (0.35) PLA2G2APLA2G4AALDH1A1MEN1POLB
SCHEMBL19986077 0.93 NPC1 (0.35) PLA2G2APLA2G4AALDH1A1MEN1POLB
SCHEMBL19986020 0.92 PLA2G2A (0.38) PLA2G2APLA2G4AALDH1A1MEN1POLB
SCHEMBL19986007 0.91 KDM4E (0.37) ALDH1A1MEN1POLBTSHRBRCA1
SCHEMBL19986042 0.91 KDM4E (0.37) ALDH1A1MEN1POLBTSHRBRCA1
SCHEMBL19986061 0.91 KDM4E (0.40) PLA2G2APLA2G4AALDH1A1MEN1POLB
SCHEMBL19986060 0.91 KDM4E (0.40) PLA2G2APLA2G4AALDH1A1MEN1POLB
SCHEMBL19986029 0.91 TDP1 (0.33) PLA2G2APLA2G4AALDH1A1MEN1POLB
SCHEMBL19986033 0.91 PLA2G2A (0.33) PLA2G2APLA2G4AALDH1A1MEN1POLB
SCHEMBL19986058 0.90 RXFP1 (0.34) ALDH1A1MEN1POLBTSHRBRCA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed